2-[[bis(diethylamino)-phenyl-$l^{5}-phosphanylidene]carbamothioylamino]ethyl-diethyl-azanium

Systemtic Name: 2-[[bis(diethylamino)-phenyl-$l^{5}-phosphanylidene]carbamothioylamino]ethyl-diethyl-azanium Openeye Name: 2-[[bis(diethylamino)-phenyl-$l^{5}-phosphanylidene]carbamothioylamino]ethyl-diethyl-ammonium CAS Name: 2-[[[[bis(diethylamino)-phenylphosphoranylidene]amino]-sulfanylidenemethyl]amino]ethyl-diethylammonium IUPAC Name: 2-[[bis(diethylamino)-phenyl-$l^{5}-phosphanylidene]carbamothioylamino]ethyl-diethylazanium Traditional Name: 2-[[bis(diethylamino)-phenyl-phosphoranylidene]thiocarbamoylamino]ethyl-diethyl-ammonium Formula: C21H41N5PS+ MolecularWeight: 426.622501

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCNC(=S)N=P(C1=CC=CC=C1)(N(CC)CC)N(CC)CC

Isomeric SMILES

CC[NH+](CC)CCNC(=S)N=P(C1=CC=CC=C1)(N(CC)CC)N(CC)CC

InChI

InChI=1S/C21H40N5PS/c1-7-24(8-2)19-18-22-21(28)23-27(25(9-3)10-4,26(11-5)12-6)20-16-14-13-15-17-20/h13-17H,7-12,18-19H2,1-6H3,(H,22,28)/p+1